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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:25 UTC
Update Date2025-03-25 00:55:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02211539
Frequency0.5
Structure
Chemical FormulaC8H14N6O3S3
Molecular Mass338.029
SMILESCC(=O)Nc1nnc(CSCCC(N)=NS(N)(=O)=O)s1
InChI KeyMVXOPQSVKCQHBT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass n-arylamides
Direct Parent n-acetylarylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • amidines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylthioethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organic sulfuric acids and derivatives
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • sulfenyl compounds
  • thiadiazoles
    • Substituents
  • carbonyl group
  • n-acetylarylamine
  • aromatic heteromonocyclic compound
  • amidine
  • organosulfur compound
  • carboxylic acid derivative
  • thiadiazole
  • organic oxide
  • organopnictogen compound
  • organoheterocyclic compound
  • acetamide
  • azole
  • organic sulfuric acid or derivatives
  • sulfenyl compound
  • azacycle
  • dialkylthioether
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • organooxygen compound